pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.02	SAMPL6	0	-1	O=C(CNC(=O)c1ccccc1)Nc1nc2ccccc2s1	""	SM10	O=C(CNC(=O)c1ccccc1)Nc1nc2ccccc2s1
